1-[4-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]butyl]-1-(1-benzothiophen-2-yl)urea

Systemtic Name: 1-[4-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]butyl]-1-(1-benzothiophen-2-yl)urea Openeye Name: 1-[4-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]butyl]-1-(benzothiophen-2-yl)urea CAS Name: 1-[4-[4-(1,3-benzodioxol-5-yl)-1-piperazinyl]butyl]-1-(1-benzothiophen-2-yl)urea IUPAC Name: 1-[4-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]butyl]-1-(1-benzothiophen-2-yl)urea Traditional Name: 1-[4-[4-(1,3-benzodioxol-5-yl)piperazino]butyl]-1-(benzothiophen-2-yl)urea Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN(C2=CC3=CC=CC=C3S2)C(=O)N)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CCCCN(C2=CC3=CC=CC=C3S2)C(=O)N)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H28N4O3S/c25-24(29)28(23-15-18-5-1-2-6-22(18)32-23)10-4-3-9-26-11-13-27(14-12-26)19-7-8-20-21(16-19)31-17-30-20/h1-2,5-8,15-16H,3-4,9-14,17H2,(H2,25,29)